Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | PRNP | P04156 | 1/20 | 0.44 |
| ▸ | CDC25B | P30305 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27411486 | 0.82 | TSHR (0.57) | TSHRKDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL1034564 | 0.81 | TSHR (0.68) | TSHRKDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL27838090 | 0.81 | TSHR (0.42) | TSHRKDM4EALDH1A1L3MBTL1GAA | |
| SCHEMBL8582386 | 0.80 | TSHR (0.55) | TSHRKDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL5861172 | 0.80 | TSHR (0.54) | TSHRKDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL124872 | 0.80 | TSHR (0.43) | TSHRKDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL5193947 | 0.79 | IKBKB (0.60) | TSHRKDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL30923332 | 0.79 | ALDH1A1 (0.54) | TSHRKDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL2203793 | 0.79 | ALDH1A1 (0.54) | TSHRKDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL27485780 | 0.78 | KDM4E (0.60) | TSHRKDM4EALDH1A1HPGDKMT2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115466212-B | 2-trifluoromethyl quinoline compound and synthetic method and application thereof | 河南农业大学 | 2023-09-22 | — | — | CN | claimed |